4-[(4-ethyl-2,3-dioxopiperazin-1-yl)methyl]-N-(3-fluoro-2-methylphenyl)benzamide
Chemical Structure Depiction of
4-[(4-ethyl-2,3-dioxopiperazin-1-yl)methyl]-N-(3-fluoro-2-methylphenyl)benzamide
4-[(4-ethyl-2,3-dioxopiperazin-1-yl)methyl]-N-(3-fluoro-2-methylphenyl)benzamide
Compound characteristics
| Compound ID: | M116-2802 |
| Compound Name: | 4-[(4-ethyl-2,3-dioxopiperazin-1-yl)methyl]-N-(3-fluoro-2-methylphenyl)benzamide |
| Molecular Weight: | 383.42 |
| Molecular Formula: | C21 H22 F N3 O3 |
| Smiles: | CCN1CCN(Cc2ccc(cc2)C(Nc2cccc(c2C)F)=O)C(C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3189 |
| logD: | 2.3079 |
| logSw: | -2.7646 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.673 |
| InChI Key: | ZBHOVPNSGBDACI-UHFFFAOYSA-N |